%chk=000155521.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155521

0 1
 O   0.3522000      -2.713700     -0.4637000    
 N    1.137900     -0.5354000     -0.1242000    
 N  -0.3022000       1.308000     -0.5406000    
 C   -1.262800     -0.9579000     -0.2981000    
 C   -1.300600      0.3664000      -1.056400    
 C   -1.766100     -0.8361000       1.145000    
 C   -2.680800       1.026400     -0.9603000    
 C   -3.149800     -0.1961000       1.200900    
 C   -3.176600       1.148000      0.4807000    
 C   0.1482000      -1.508300     -0.3215000    
 C   0.8341000      0.8210000     -0.1717000    
 C    2.524300      -1.002400     -4.3000001E-02
 C    1.877600       1.802200      0.3286000    
 C    3.458100     -6.0300000E-02  0.6948000    
 C    3.306200       1.338300      0.1294000    
 H   -1.902400      -1.674800     -0.8308000    
 H   -1.076900      0.1933000      -2.117500    
 H   -1.068900     -0.2460000       1.753100    
 H   -1.803900      -1.829700       1.608500    
 H   -3.401500      0.4283000      -1.532500    
 H   -2.658100       2.021900      -1.419900    
 H   -3.451900     -6.1400000E-02   2.245600    
 H   -3.882400     -0.8710000      0.7414000    
 H   -4.197900       1.545600      0.4837000    
 H   -2.555000       1.868100       1.026600    
 H    2.867500      -1.135300      -1.076800    
 H    2.550700      -1.990900      0.4299000    
 H    1.729700       2.767600     -0.1692000    
 H    1.681300       1.960300       1.396600    
 H    4.493300     -0.4026000      0.5907000    
 H    3.220200     -5.8800001E-02   1.765500    
 H    3.558700       1.341500     -0.9378000    
 H    3.995800       2.025800      0.6311000    


%chk=000155521-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155521

0 1
O 0.421117 -2.758181 -0.318719
N 1.166287 -0.547100 -0.156806
N -0.312594 1.332597 -0.551579
C -1.273914 -0.971713 -0.261648
C -1.325608 0.359083 -1.059689
C -1.785871 -0.785421 1.199184
C -2.729462 1.000304 -1.008932
C -3.204866 -0.170332 1.208250
C -3.230513 1.173935 0.442352
C 0.148905 -1.523631 -0.267279
C 0.837290 0.854897 -0.155627
C 2.581989 -1.025081 -0.154386
C 1.880335 1.807147 0.411399
C 3.512144 -0.096327 0.639865
C 3.339212 1.362367 0.170007
H -1.911023 -1.728932 -0.754932
H -1.070624 0.147151 -2.122359
H -1.098758 -0.118177 1.756144
H -1.779559 -1.766195 1.710023
H -3.435724 0.359593 -1.575185
H -2.683231 1.979456 -1.520016
H -3.541158 -0.025232 2.252918
H -3.916344 -0.880295 0.737221
H -4.253316 1.596654 0.441014
H -2.575628 1.903711 0.958505
H 2.928908 -1.094162 -1.205462
H 2.571149 -2.050473 0.250135
H 1.672021 2.805808 -0.005310
H 1.709178 1.873384 1.506258
H 4.553805 -0.439168 0.496896
H 3.287000 -0.169504 1.721993
H 3.588776 1.439298 -0.907081
H 4.028078 2.036537 0.710944


